SCHEMBL6966092

SCHEMBL6966092

CC(=O)OC1(c2ccccc2)CCN(CCCN)CC1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 2/20 0.57
DRD2 P14416 2/20 0.52
DRD4 P21917 1/20 0.52
ADRA1A P35348 2/20 0.49
ADRA1D P25100 1/20 0.48
ADRA1B P35368 1/20 0.48
OPRM1 P35372 4/20 0.45
OPRD1 P41143 4/20 0.45
OPRK1 P41145 4/20 0.45
KCNA3 P22001 1/20 0.45
SIGMAR1 Q99720 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL614396 0.83 DRD3 (0.52) DRD3DRD2DRD4OPRM1OPRD1
SCHEMBL7242386 0.82 OPRM1 (0.51) DRD3DRD2OPRM1OPRD1OPRK1
SCHEMBL6643987 0.80 OPRM1 (0.53) ADRA1AADRA1DADRA1BOPRM1OPRD1
SCHEMBL905002 0.79 DRD3 (0.57) DRD3DRD2DRD4ADRA1AADRA1D
SCHEMBL6964398 0.79 ADRA1A (0.52) DRD3DRD2DRD4ADRA1AADRA1D
SCHEMBL6196008 0.77 ADRA1D (0.62) ADRA1AADRA1DADRA1BOPRM1OPRD1
SCHEMBL11465399 0.76 DRD3 (0.44) DRD3DRD2DRD4ADRA1AADRA1D
SCHEMBL6195779 0.76 SIGMAR1 (0.57) DRD4ADRA1AOPRM1SIGMAR1
SCHEMBL6197539 0.75 KCNA3 (0.77) ADRA1AOPRM1OPRD1OPRK1KCNA3
SCHEMBL6686824 0.75 SIGMAR1 (0.53) ADRA1ASIGMAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620815-B1 Selective antagonists for human alpha 1A receptors; benign prostatic hyperplasia, impotency, cardiac arrhythmia treatment; anticholesterol agents; intraocular pressure reduction SYNAPTIC PHARMACEUTICAL CORPORATION 2003-09-16 US disclosed
EP-0988295-A4 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2003-08-13 EP disclosed
US-6159990-A Oxazolidinones as α1A receptor antagonists SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-12-12 US disclosed
EP-0988295-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-03-29 EP disclosed
WO-1998057940-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-12-23 WO disclosed